(741b) Force Fields, Algorithms, and Software for Phase Behavior and Physical Property Prediction | AIChE

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(741b) Force Fields, Algorithms, and Software for Phase Behavior and Physical Property Prediction

Authors 

Potoff, J. - Presenter, Wayne State University
In this talk, the modern history of force fields, algorithms, and software for phase behavior and physical property prediction is discussed. Notable examples are highlighted, and the current state of the art is presented.

Topics 

Computational Molecular Engineering
Physical Properties
Thermodynamics

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